SCHEMBL11021775

SCHEMBL11021775

CCOCCOCCOCCC[Si](OCC)(OCC)OCC

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 3/20 0.32
MEN1 O00255 1/20 0.31
THRB P10828 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
CYP3A4 P08684 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3214360 1.00 ALDH1A1 (0.33) ALDH1A1TSHRMEN1THRBHTT
SCHEMBL3889706 0.95 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL15705449 0.95 MEN1 (0.33) TSHRMEN1THRBHTTKMT2A
SCHEMBL3503366 0.93 TSHR (0.33) TSHRMEN1THRBHTTKMT2A
Methylamine SCHEMBL9222802 0.91 ALDH1A1 (0.33) ALDH1A1
SCHEMBL17991841 0.91 TSHR (0.32) TSHR
SCHEMBL11020286 0.89 TSHR (0.43) ALDH1A1TSHRMEN1THRBHTT
SCHEMBL31485687 0.87 CYP3A4 (0.32) TSHRCYP3A4
SCHEMBL11018766 0.87 CYP3A4 (0.32) TSHRCYP3A4
SCHEMBL3224297 0.87 CYP3A4 (0.32) TSHRCYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0160988-A2 Stable silica-based ether bonded phases for biopolymer separations BECKMAN INSTRUMENTS, INC. (US) 1985-11-13 EP disclosed